platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid

C18H14F3N4O2Pt- — CID 59645844

About platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid

platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid (PubChem CID 59645844) has the molecular formula C18H14F3N4O2Pt- and a molecular weight of 570.41 g/mol. Its IUPAC name is platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid.

Molecular Properties

• Compound Name: platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid
• PubChem CID: 59645844
• Molecular Formula: C18H14F3N4O2Pt-
• Molecular Weight: 570.41 g/mol
• Exact Mass: 570.07
• IUPAC Name: platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid
• SMILES: CC(C)(c1cccc(C(=O)O)n1)c1cccc(-c2cc(C(F)(F)F)n[n-]2)n1.[Pt]
• InChI: InChI=1S/C18H15F3N4O2.Pt/c1-17(2,14-8-4-6-11(23-14)16(26)27)13-7-3-5-10(22-13)12-9-15(25-24-12)18(19,20)21;/h3-9H,1-2H3,(H2,22,24,25,26,27);/p-1
• InChIKey: YNROFYDGEFKRJV-UHFFFAOYSA-M
• XLogP: 3.54
• TPSA: 90.07 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	570.41
LogP ≤ 5	3.54
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid?

The IUPAC name of platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid (CID 59645844) is platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid.

What is the SMILES notation for platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid?

The canonical SMILES for platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid is CC(C)(c1cccc(C(=O)O)n1)c1cccc(-c2cc(C(F)(F)F)n[n-]2)n1.[Pt].

What is the InChIKey of platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid?

The InChIKey is YNROFYDGEFKRJV-UHFFFAOYSA-M. The full InChI is InChI=1S/C18H15F3N4O2.Pt/c1-17(2,14-8-4-6-11(23-14)16(26)27)13-7-3-5-10(22-13)12-9-15(25-24-12)18(19,20)21;/h3-9H,1-2H3,(H2,22,24,25,26,27);/p-1.

What are the key properties of platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid?

platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid has a molecular weight of 570.41 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for platinum;6-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid is sourced from PubChem (CID 59645844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).